[(3R,4S,5S,6S)-4,5-diacetyloxy-6-(nitromethyl)oxan-3-yl] ethanoate

Systemtic Name: [(3R,4S,5S,6S)-4,5-diacetyloxy-6-(nitromethyl)oxan-3-yl] ethanoate Openeye Name: [(3R,4S,5S,6S)-4,5-diacetoxy-6-(nitromethyl)tetrahydropyran-3-yl] acetate CAS Name: acetic acid [(3R,4S,5S,6S)-4,5-diacetyloxy-6-(nitromethyl)-3-oxanyl] ester IUPAC Name: [(3R,4S,5S,6S)-4,5-diacetyloxy-6-(nitromethyl)oxan-3-yl] acetate Traditional Name: acetic acid [(3R,4S,5S,6S)-4,5-diacetoxy-6-(nitromethyl)tetrahydropyran-3-yl] ester Formula: C12H17NO9 MolecularWeight: 319.26468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)C[N+](=O)[O-]

Isomeric SMILES

CC(=O)O[C@@H]1CO[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)C[N+](=O)[O-]

InChI

InChI=1S/C12H17NO9/c1-6(14)20-10-5-19-9(4-13(17)18)11(21-7(2)15)12(10)22-8(3)16/h9-12H,4-5H2,1-3H3/t9-,10+,11-,12-/m0/s1